SCHEMBL6675434

SCHEMBL6675434

C=CC(CCCCC)OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CETP P11597 3/20 0.40
CSNK1E P49674 1/20 0.40
CNR2 P34972 1/20 0.39
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
CTRC Q99895 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11733830 1.00 CETP (0.40) CETPCSNK1ECNR2BCHEACHE
SCHEMBL6678199 0.98 CETP (0.42) CETPCSNK1ECNR2BCHEACHE
SCHEMBL9498100 0.84 CETP (0.43) CETPCSNK1ECNR2
SCHEMBL2367124 0.83 CETP (0.46) CETPCSNK1ECNR2CTRC
SCHEMBL8709152 0.83 TSHR (0.33)
SCHEMBL8707834 0.83 TSHR (0.33)
SCHEMBL6811532 0.83 TSHR (0.33)
SCHEMBL2367121 0.83 CETP (0.46) CETPCSNK1ECNR2CTRC
SCHEMBL8711766 0.83 TSHR (0.35) BCHE
SCHEMBL7763433 0.83 FAAH (0.37) BCHE

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0831113-B1 ALKYLATED POROUS RESIN, PROCESS FOR PRODUCTION THEREOF, AND USE THEREOF ARAKAWA CHEM IND (JP) 2004-11-03 EP disclosed
US-5880240-A POLYMER PREPARED BY POLYMERIZING MIXTURE OF DIVINYLBENZENE, MONOMER SELECTED FROM STYRENE, METHYLSTYRENE AND ETHYLVINYLBENZENE, AND VINYLBENZYLOXYALKANE DERIVATIVE ARAKAWA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-09 US disclosed
EP-0831113-A1 ALKYLATED POROUS RESIN, PROCESS FOR PRODUCTION THEREOF, AND USE THEREOF ARAKAWA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-25 EP disclosed
US-4022794-A VASODILATION MERCK & CO., INC. (US) 1977-05-10 US disclosed